(5-fluoroquinolin-8-yl)-(4-hydroxy-1-azaspiro[4.4]nonan-1-yl)methanone

C18H19FN2O2 — CID 138017112

IUPAC(5-fluoroquinolin-8-yl)-(4-hydroxy-1-azaspiro[4.4]nonan-1-yl)methanone
SMILESO=C(c1ccc(F)c2cccnc12)N1CCC(O)C12CCCC2
InChIInChI=1S/C18H19FN2O2/c19-14-6-5-13(16-12(14)4-3-10-20-16)17(23)21-11-7-15(22)18(21)8-1-2-9-18/h3-6,10,15,22H,1-2,7-9,11H2
InChIKeyRYTFRAVJBPFWIB-UHFFFAOYSA-N
MW314.36 g/mol
LogP2.89
Rot. Bonds1

About (5-fluoroquinolin-8-yl)-(4-hydroxy-1-azaspiro[4.4]nonan-1-yl)methanone

(5-fluoroquinolin-8-yl)-(4-hydroxy-1-azaspiro[4.4]nonan-1-yl)methanone (PubChem CID 138017112) has the molecular formula C18H19FN2O2 and a molecular weight of 314.36 g/mol. Its IUPAC name is (5-fluoroquinolin-8-yl)-(4-hydroxy-1-azaspiro[4.4]nonan-1-yl)methanone.

Molecular Properties

Compound Name(5-fluoroquinolin-8-yl)-(4-hydroxy-1-azaspiro[4.4]nonan-1-yl)methanone
PubChem CID138017112
Molecular FormulaC18H19FN2O2
Molecular Weight314.36 g/mol
Exact Mass314.14
IUPAC Name(5-fluoroquinolin-8-yl)-(4-hydroxy-1-azaspiro[4.4]nonan-1-yl)methanone
SMILESO=C(c1ccc(F)c2cccnc12)N1CCC(O)C12CCCC2
InChIInChI=1S/C18H19FN2O2/c19-14-6-5-13(16-12(14)4-3-10-20-16)17(23)21-11-7-15(22)18(21)8-1-2-9-18/h3-6,10,15,22H,1-2,7-9,11H2
InChIKeyRYTFRAVJBPFWIB-UHFFFAOYSA-N
XLogP2.89
TPSA53.43 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.36
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (5-fluoroquinolin-8-yl)-(4-hydroxy-1-azaspiro[4.4]nonan-1-yl)methanone with MolForge

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Related Compounds

4-(5-fluoroquinoline-8-carbonyl)-1-methyl-3-phenylpiperazin-2-one
CID 166384473
azetidin-1-yl-(5-chloroquinolin-8-yl)methanone
CID 166196760
(5-chloroquinolin-8-yl)-[3-(methylamino)piperidin-1-yl]methanone
CID 119491888
(4-hydroxy-1-azaspiro[4.4]nonan-1-yl)-(5-methyl-1H-indazol-7-yl)methanone
CID 128534632
1-(azepan-1-yl)-2-[4-[(5-fluoroquinolin-8-yl)methyl]piperazin-1-yl]ethanone
CID 55680173
(4-amino-3,3-dimethylpiperidin-1-yl)-(5-chloroquinolin-8-yl)methanone
CID 120818978
[(1R,8S)-5-(3,5-difluorophenyl)-4-methyl-3,4,12-triazatricyclo[6.3.1.02,6]dodeca-2,5-dien-12-yl]-(8-fluoroquinolin-5-yl)methanone
CID 160798606
1-[(5-fluoroquinolin-8-yl)methyl]-N-methylpyrrolidin-3-amine
CID 81493159
4-hydroxy-1-(5-nitroquinoline-8-carbonyl)piperidine-4-carboxylic acid
CID 120528257
(5-fluoroquinolin-8-yl)methyl 1-propanoylpiperidine-3-carboxylate
CID 55996017
8-[(5-fluoroquinolin-8-yl)methyl]-8-azabicyclo[3.2.1]octan-3-ol
CID 63770132
8-hydroxyquinoline-5-carboxylic acid;hydrobromide
CID 122236270

Frequently Asked Questions

What is the IUPAC name of (5-fluoroquinolin-8-yl)-(4-hydroxy-1-azaspiro[4.4]nonan-1-yl)methanone?
The IUPAC name of (5-fluoroquinolin-8-yl)-(4-hydroxy-1-azaspiro[4.4]nonan-1-yl)methanone (CID 138017112) is (5-fluoroquinolin-8-yl)-(4-hydroxy-1-azaspiro[4.4]nonan-1-yl)methanone.
What is the SMILES notation for (5-fluoroquinolin-8-yl)-(4-hydroxy-1-azaspiro[4.4]nonan-1-yl)methanone?
The canonical SMILES for (5-fluoroquinolin-8-yl)-(4-hydroxy-1-azaspiro[4.4]nonan-1-yl)methanone is O=C(c1ccc(F)c2cccnc12)N1CCC(O)C12CCCC2.
What is the InChIKey of (5-fluoroquinolin-8-yl)-(4-hydroxy-1-azaspiro[4.4]nonan-1-yl)methanone?
The InChIKey is RYTFRAVJBPFWIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19FN2O2/c19-14-6-5-13(16-12(14)4-3-10-20-16)17(23)21-11-7-15(22)18(21)8-1-2-9-18/h3-6,10,15,22H,1-2,7-9,11H2.
What are the key properties of (5-fluoroquinolin-8-yl)-(4-hydroxy-1-azaspiro[4.4]nonan-1-yl)methanone?
(5-fluoroquinolin-8-yl)-(4-hydroxy-1-azaspiro[4.4]nonan-1-yl)methanone has a molecular weight of 314.36 g/mol, XLogP of 2.89, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-fluoroquinolin-8-yl)-(4-hydroxy-1-azaspiro[4.4]nonan-1-yl)methanone is sourced from PubChem (CID 138017112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).